propyl 4-[[6-[(4-fluorophenyl)methyl]-5-oxidanylidene-thiomorpholin-3-yl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[6-[(4-fluorophenyl)methyl]-5-oxidanylidene-thiomorpholin-3-yl]carbonylamino]benzoate Openeye Name: propyl 4-[[6-[(4-fluorophenyl)methyl]-5-oxo-thiomorpholine-3-carbonyl]amino]benzoate CAS Name: 4-[[[6-[(4-fluorophenyl)methyl]-5-oxo-3-thiomorpholinyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[6-[(4-fluorophenyl)methyl]-5-oxothiomorpholine-3-carbonyl]amino]benzoate Traditional Name: 4-[[6-(4-fluorobenzyl)-5-keto-thiomorpholine-3-carbonyl]amino]benzoic acid propyl ester Formula: C22H23FN2O4S MolecularWeight: 430.492423

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CSC(C(=O)N2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CSC(C(=O)N2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H23FN2O4S/c1-2-11-29-22(28)15-5-9-17(10-6-15)24-20(26)18-13-30-19(21(27)25-18)12-14-3-7-16(23)8-4-14/h3-10,18-19H,2,11-13H2,1H3,(H,24,26)(H,25,27)